0 mol 0 unq 0 iso 0 dist 9.1936 5.93783 8.65478 10.564 13.4692 9.16606 numMergedOcc 0
1 mol 5 unq 0 iso 0 dist 7.67309 10.619 7.88567 12.1997 5.34991 6.99733 numMergedOcc 0
2 mol 10 unq 0 iso 0 dist 4.89792 8.2927 7.30932 10.2862 6.62276 7.5169 numMergedOcc 0
3 mol 44 unq 0 iso 0 dist 9.26518 4.83564 5.89913 9.03899 4.94258 6.11574 numMergedOcc 0
4 mol 48 unq 0 iso 0 dist 8.61432 15.1557 9.90758 12.7019 5.87234 7.88961 numMergedOcc 0
5 mol 54 unq 0 iso 0 dist 6.6367 5.95619 7.62814 10.2028 4.04498 9.96522 numMergedOcc 0
6 mol 54 unq 1 iso 0 dist 9.63946 12.9438 7.62814 12.3634 4.04498 9.96522 numMergedOcc 0
7 mol 64 unq 0 iso 0 dist 8.85601 10.0706 9.05343 9.41957 7.81738 5.45684 numMergedOcc 0
8 mol 64 unq 1 iso 0 dist 8.85601 10.0706 9.05343 11.9315 5.92555 7.66372 numMergedOcc 0
9 mol 64 unq 2 iso 0 dist 8.85601 5.05714 7.71528 9.41957 7.81738 7.76644 numMergedOcc 0
10 mol 64 unq 3 iso 0 dist 8.85601 5.05714 7.71528 11.9315 5.92555 9.99743 numMergedOcc 0
11 mol 98 unq 0 iso 0 dist 5.58102 5.37488 5.85622 11.5097 14.7898 9.20236 numMergedOcc 0
12 mol 101 unq 0 iso 0 dist 9.05284 4.45934 6.54699 11.4305 6.43467 7.11476 numMergedOcc 0
13 mol 124 unq 0 iso 0 dist 6.67979 5.87352 9.66083 6.31955 5.3096 8.03603 numMergedOcc 0
14 mol 172 unq 0 iso 0 dist 9.66616 8.65462 7.3485 12.8066 9.6831 5.28889 numMergedOcc 0
15 mol 172 unq 1 iso 0 dist 9.66616 8.65462 7.3485 6.16303 7.16279 4.90175 numMergedOcc 0
16 mol 184 unq 0 iso 0 dist 9.98096 9.23342 9.511 12.0399 6.83738 8.49577 numMergedOcc 0
17 mol 184 unq 1 iso 0 dist 8.24035 9.23342 7.72354 12.0399 4.57656 8.49577 numMergedOcc 0
18 mol 186 unq 0 iso 0 dist 8.86574 4.95637 7.62945 5.82681 5.28021 7.6409 numMergedOcc 0
19 mol 193 unq 0 iso 0 dist 8.29723 13.8145 6.10013 8.71649 4.8988 8.71993 numMergedOcc 0
20 mol 241 unq 0 iso 0 dist 7.65636 4.51587 9.87415 9.89398 8.58146 8.00841 numMergedOcc 0
21 mol 254 unq 0 iso 0 dist 9.31593 16.3514 9.47133 13.8574 5.9731 5.73448 numMergedOcc 0
22 mol 254 unq 1 iso 0 dist 9.31593 16.3514 9.47133 20.8052 11.7647 9.54526 numMergedOcc 0
23 mol 270 unq 0 iso 0 dist 7.96508 10.7893 5.2559 12.5407 4.68028 6.32507 numMergedOcc 0
